6473-13-8 Purity
98%
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Specification
The molecular formula of Direct Yellow 29 is C42H24N6Na2O6S6.
The molecular weight of Direct Yellow 29 is 947.1 g/mol.
Some synonyms for Direct Yellow 29 are C.I. 19556, C.I. Direct Yellow 29, and NSC-326208.
Direct Yellow 29 was created on 2009-08-08 and last modified on 2023-12-23.
The IUPAC name of Direct Yellow 29 is disodium;6-methyl-2-[2-[4-[[4-[6-(6-methyl-7-sulfonato-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-yl]phenyl]diazenyl]phenyl]-1,3-benzothiazol-6-yl]-1,3-benzothiazole-7-sulfonate.
The InChIKey of Direct Yellow 29 is ZZMVQXGPIIXLMO-UHFFFAOYSA-L.
The canonical SMILES representation of Direct Yellow 29 is CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC=C(C=C5)N=NC6=CC=C(C=C6)C7=NC8=C(S7)C=C(C=C8)C9=NC1=C(S9)C(=C(C=C1)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].
The CAS number for Direct Yellow 29 is 6537-66-2.
Direct Yellow 29 has 16 hydrogen bond acceptor counts.
The topological polar surface area of Direct Yellow 29 is 320 Å2.
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